SCHEMBL784333

SCHEMBL784333

CC(C)n1cnc2c(=O)[nH]cnc21

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.51
ADORA2B P29275 1/20 0.51
ADORA1 P30542 1/20 0.51
PI4KA P42356 1/20 0.51
PI4K2B Q8TCG2 1/20 0.51
PI4K2A Q9BTU6 1/20 0.51
PI4KB Q9UBF8 1/20 0.51
HPRT1 P00492 10/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 1/20 0.49
CDK1 P06493 1/20 0.46
CCNB1 P14635 1/20 0.46
CCNE1 P24864 1/20 0.46
CDK2 P24941 1/20 0.46
PNP P00491 2/20 0.42
LMNA P02545 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21417461 0.87 HPRT1 (0.50) HPRT1MEN1KMT2AALDH1A1PNP
SCHEMBL21127932 0.87 HPRT1 (0.47) ADORA2AADORA2BADORA1PI4KAPI4K2B
SCHEMBL23228187 0.84 HPRT1 (0.45) HPRT1PNP
SCHEMBL21625880 0.84 ADORA2A (0.56) ADORA2AADORA2BADORA1HPRT1MEN1
SCHEMBL11243652 0.83 HPRT1 (0.49) HPRT1ALDH1A1PNPLMNA
SCHEMBL7396872 0.83 HPRT1 (0.46) HPRT1PNP
SCHEMBL25101151 0.82 CDK1 (0.39) ADORA2AADORA2BADORA1PI4KAPI4K2B
SCHEMBL21385661 0.82 HPRT1 (0.55) HPRT1MEN1KMT2AALDH1A1PNP
SCHEMBL23619296 0.82 HPRT1 (0.46) ADORA2AADORA2BADORA1HPRT1MEN1
SCHEMBL3060812 0.82 HPRT1 (0.45) HPRT1PNP

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 289 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240240182-A1 HUMAN CHROMOSOME 9 OPEN READING FRAME 72 (C9ORF72) iRNA AGENT COMPOSITIONS AND METHODS OF USE THEREOF BANK OF AMERICA, N.A. 2024-07-18 US disclosed
US-20240240182-A1 HUMAN CHROMOSOME 9 OPEN READING FRAME 72 (C9ORF72) iRNA AGENT COMPOSITIONS AND METHODS OF USE THEREOF BANK OF AMERICA, N.A. 2024-07-18 US disclosed
US-12030911-B2 Synthesis and biological activity of phosphoramidimidate and phosphoramidate DNA THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2024-07-09 US disclosed
US-20240209373-A1 ELONGATION OF VERY LONG CHAIN FATTY ACIDS PROTEIN 1 (ELOVL1) iRNA AGENT COMPOSITIONS AND METHODS OF USE THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2024-06-27 US disclosed
US-20240209339-A1 REDIRECTING RISC FOR RNA EDITING ALNYLAM PHARMACEUTICALS, INC. (US) 2024-06-27 US disclosed
US-20240209339-A1 REDIRECTING RISC FOR RNA EDITING ALNYLAM PHARMACEUTICALS, INC. (US) 2024-06-27 US disclosed
US-20240209017-A1 STING MODULATOR COMPOUNDS, AND METHODS OF MAKING AND USING TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-06-27 US disclosed
US-20240209374-A1 iRNA COMPOSITIONS AND METHODS FOR SILENCING CHITINASE 3-LIKE PROTEIN 1/YKL-40 (CHI3L1/YKL-40) PROTEIN ALNYLAM PHARMACEUTICALS, INC. (US) 2024-06-27 US disclosed
US-20240209374-A1 iRNA COMPOSITIONS AND METHODS FOR SILENCING CHITINASE 3-LIKE PROTEIN 1/YKL-40 (CHI3L1/YKL-40) PROTEIN ALNYLAM PHARMACEUTICALS, INC. (US) 2024-06-27 US disclosed
US-20240209017-A1 STING MODULATOR COMPOUNDS, AND METHODS OF MAKING AND USING TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-06-27 US disclosed
US-20090281299-A1 OLIGONUCLEOTIDES COMPRISING A NON-PHOSPHATE BACKBONE LINKAGE ALNYLAM PHARMACEUTICALS, INC. (US) 2009-11-12 US disclosed
US-7615618-B2 Oligonucleotides comprising a non-phosphate backbone linkage ALNYLAM PHARMACEUTICALS, INC. (US) 2009-11-10 US disclosed
US-7615618-B2 Oligonucleotides comprising a non-phosphate backbone linkage ALNYLAM PHARMACEUTICALS, INC. (US) 2009-11-10 US disclosed
US-7608599-B2 Antiviral phosphoramidates ROCHE PALO ALTO LLC (US) 2009-10-27 US disclosed
US-20080193452-A1 Therapeutic Compounds Derived from Spider Venom and Their Method of Use CORNELL RESEARCH FOUNDATION, INC. (US) 2008-08-14 US disclosed
US-7339054-B2 Process for preparing branched ribonucleosides from 1,2-anhydroribofuranose intermediates MERCK & CO., INC. (US) 2008-03-04 US disclosed
US-20070054279-A1 Oligonucleotides comprising a ligand tethered to a modified or non-natural nucleobase ALNYLAM PHARMACEUTICALS (US) 2007-03-08 US disclosed
US-20070054279-A1 Oligonucleotides comprising a ligand tethered to a modified or non-natural nucleobase ALNYLAM PHARMACEUTICALS (US) 2007-03-08 US disclosed
US-20070042988-A1 Antiviral phosphoramidates ROCHE PALO ALTO LLC 2007-02-22 US disclosed
US-20070037771-A1 Reacting 2-Anhydro-3,5-di-O-(p-toluoyl)-2-C-methyl- alpha -D-ribofuranose with nucleophile such as cytosine, uracil, thymine, hypoxanthine, adenine, guanine, 7-deazaguanine, 7-deazaadenine, 7-deaza-2,6-diaminopurine, and 7-deazahypoxanthine, removing hydroxyl protecting groups MERCK SHARP & DOHME CORP. 2007-02-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12030911-B2 Synthesis and biological activity of phosphoramidimidate and phosphoramidate DNA RNASEH1, RNASE1, DNASE1 ADORA2A 1751/4885ADORA2B 1613/4885ADORA1 1203/4885
US-20080193452-A1 Therapeutic Compounds Derived from Spider Venom and Their Method of Use ADAR, FUT5, CSGALNACT1 ADORA2A 34/4885ADORA2B 43/4885ADORA1 77/4885
US-20070042988-A1 Antiviral phosphoramidates RPP30, RNASE1, ADORA2B ADORA2A 131/4885ADORA2B 3/4885ADORA1 22/4885
US-20090281299-A1 OLIGONUCLEOTIDES COMPRISING A NON-PHOSPHATE BACKBONE LINKAGE DUT, PNP, RNGTT ADORA2A 569/4885ADORA2B 876/4885ADORA1 525/4885
US-20240209017-A1 STING MODULATOR COMPOUNDS, AND METHODS OF MAKING AND USING STING1, CGAS, MAVS ADORA2A 312/4885ADORA2B 609/4885ADORA1 464/4885
US-20240209339-A1 REDIRECTING RISC FOR RNA EDITING ADAR, AGO2, METTL16 ADORA2A 422/4885ADORA2B 780/4885ADORA1 608/4885
US-20240209374-A1 iRNA COMPOSITIONS AND METHODS FOR SILENCING CHITINASE 3-LIKE PROTEIN 1/YKL-40 (CHI3L1/YKL-40) PROTEIN CHI3L1, CHIA, CHI3L2 ADORA2A 3823/4885ADORA2B 3889/4885ADORA1 2776/4885
US-20070054279-A1 Oligonucleotides comprising a ligand tethered to a modified or non-natural nucleobase DERA, NT5C3B, DUT ADORA2A 186/4885ADORA2B 474/4885ADORA1 249/4885
US-20070037771-A1 Reacting 2-Anhydro-3,5-di-O-(p-toluoyl)-2-C-methyl- alpha -D-ribofuranose with nucleophile such as cytosine, uracil, thymine, hypoxanthine, adenine, guanine, 7-deazaguanine, 7-deazaadenine, 7-deaza-2,6-diaminopurine, and 7-deazahypoxanthine, removing hydroxyl protecting groups DUT, RNGTT, DPYD ADORA2A 81/4885ADORA2B 232/4885ADORA1 220/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.